N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide

C20H23N3O4 — CID 113163156

IUPACN-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccc(CN(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)cc1
InChIInChI=1S/C20H23N3O4/c1-14(24)21-17-6-8-18(9-7-17)22-20(26)13-23(15(2)25)12-16-4-10-19(27-3)11-5-16/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyKXQKTLJFTAERKT-UHFFFAOYSA-N
MW369.42 g/mol
LogP2.64
Rot. Bonds7

About N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide

N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide (PubChem CID 113163156) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
PubChem CID113163156
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC NameN-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
SMILESCOc1ccc(CN(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)cc1
InChIInChI=1S/C20H23N3O4/c1-14(24)21-17-6-8-18(9-7-17)22-20(26)13-23(15(2)25)12-16-4-10-19(27-3)11-5-16/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyKXQKTLJFTAERKT-UHFFFAOYSA-N
XLogP2.64
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide (CID 113163156) is N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide is COc1ccc(CN(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide?
The InChIKey is KXQKTLJFTAERKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-14(24)21-17-6-8-18(9-7-17)22-20(26)13-23(15(2)25)12-16-4-10-19(27-3)11-5-16/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,26).
What are the key properties of N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide?
N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide has a molecular weight of 369.42 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide is sourced from PubChem (CID 113163156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).